2,4,6-tris(iodanyl)-3-isocyano-5-(4-methyl-3-nitro-phenyl)benzenecarbonitrile

Systemtic Name: 2,4,6-tris(iodanyl)-3-isocyano-5-(4-methyl-3-nitro-phenyl)benzenecarbonitrile Openeye Name: 2,4,6-triiodo-3-isocyano-5-(4-methyl-3-nitro-phenyl)benzonitrile CAS Name: 2,4,6-triiodo-3-isocyano-5-(4-methyl-3-nitrophenyl)benzonitrile IUPAC Name: 2,4,6-triiodo-3-isocyano-5-(4-methyl-3-nitrophenyl)benzonitrile Traditional Name: 2,4,6-triiodo-3-isocyano-5-(4-methyl-3-nitro-phenyl)benzonitrile Formula: C15H6I3N3O2 MolecularWeight: 640.94045

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=C(C(=C(C(=C2I)C#N)I)[N+]#[C-])I)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C2=C(C(=C(C(=C2I)C#N)I)[N+]#[C-])I)[N+](=O)[O-]

InChI

InChI=1S/C15H6I3N3O2/c1-7-3-4-8(5-10(7)21(22)23)11-12(16)9(6-19)13(17)15(20-2)14(11)18/h3-5H,1H3